Commit | Date | |
---|---|---|
[r17563]
by
bugman
Fix for the N_state_model.test_monte_carlo_sims due to the changed sphere.pdb test suite file. |
2012-09-25 14:41:25 | Tree |
[r17562]
by
bugman
Relaxation data is no longer loaded by relax_data.read if the values and errors are both None. |
2012-09-25 14:37:03 | Tree |
[r17561]
by
bugman
Modified the Mf.test_dauvergne_protocol system test to catch bug #20197 (https://gna.org/bugs/?20197). The sphere test data NE1 and HE1 data is now being used in this system test, triggering the bug. |
2012-09-25 13:21:43 | Tree |
[r17560]
by
bugman
Small change to the sphere model model-free test suite data. The trptophan indole data is now merged into the last residue (a glycine) to catch bug #20197 |
2012-09-25 13:18:23 | Tree |
[r17559]
by
bugman
The overfit_deselect() printouts are now regularised and match the model-free printouts. |
2012-09-25 13:06:25 | Tree |
2012-09-25 13:01:37 | Tree | |
[r17557]
by
bugman
Printouts for the over-fitting deselection of spins are suppressed for the back-calculation of relaxation data. This affects the model-free Monte Carlo simulations, simplifying the output. |
2012-09-25 12:58:22 | Tree |
2012-09-25 12:53:03 | Tree | |
[r17555]
by
bugman
Improved the model-free overfitting deselection printouts prior to optimisation. Only a single message per spin is now given when the spin is deselected, minimising the amount of |
2012-09-25 12:38:21 | Tree |
[r17554]
by
bugman
Added a tryptophan NE1 data set to the sphere model-free model test data. This is in preparation to catch bug #20197 (https://gna.org/bugs/?20197). The scripts have also been updated for the newer relax designs. |
2012-09-25 12:05:41 | Tree |